Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dy6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N VAL 1.A O no hydrogen 3.137 N/A ALA 6.A N ALA 2.A O no hydrogen 3.322 N/A PHE 7.A N ASP 3.A O no hydrogen 3.193 N/A SER 8.A N LEU 4.A O no hydrogen 3.235 N/A SER 8.A OG LEU 4.A O no hydrogen 2.769 N/A LYS 9.A N LYS 5.A O no hydrogen 3.320 N/A HIS 10.A N ALA 6.A O no hydrogen 3.075 N/A ILE 11.A N PHE 7.A O no hydrogen 3.081 N/A TYR 12.A N SER 8.A O no hydrogen 2.984 N/A ASN 13.A N LYS 9.A O no hydrogen 3.068 N/A ALA 14.A N HIS 10.A O no hydrogen 3.189 N/A TYR 15.A N ILE 11.A O no hydrogen 2.916 N/A TYR 15.A OH ASP 163.A OD1 no hydrogen 2.787 N/A LEU 16.A N TYR 12.A O no hydrogen 2.994 N/A LYS 17.A N ASN 13.A O no hydrogen 2.824 N/A ASN 18.A N TYR 15.A O no hydrogen 3.151 N/A ASN 18.A ND2 ALA 14.A O no hydrogen 2.614 N/A ASN 18.A ND2 SER 84.A OG no hydrogen 3.272 N/A PHE 19.A N TYR 15.A O no hydrogen 3.089 N/A ASN 20.A N GLU 77.A OE2 no hydrogen 3.111 N/A ASN 20.A ND2.B ASN 125.A OD1 no hydrogen 2.674 N/A LYS 23.A N ASP 163.A OD1 no hydrogen 2.857 N/A LYS 23.A NZ ASN 157.A OD1 no hydrogen 3.523 N/A LYS 23.A NZ LEU 161.A O no hydrogen 3.024 N/A LYS 24.A N ASP 163.A OD2 no hydrogen 3.168 N/A LYS 25.A N THR 22.A OG1 no hydrogen 2.858 N/A ALA 26.A N THR 22.A O no hydrogen 3.042 N/A ARG 27.A N LYS 23.A O no hydrogen 2.817 N/A SER 28.A N LYS 24.A O no hydrogen 3.305 N/A SER 28.A OG LYS 24.A O no hydrogen 3.273 N/A SER 28.A OG LYS 25.A O no hydrogen 2.812 N/A ILE 29.A N LYS 25.A O no hydrogen 3.294 N/A LEU 30.A N ALA 26.A O no hydrogen 2.804 N/A THR 31.A OG1 ARG 27.A O no hydrogen 2.539 N/A PHE 34.A N SER 127.A O no hydrogen 2.841 N/A ILE 36.A N PHE 129.A O no hydrogen 2.736 N/A HIS 37.A N THR 41.A OG1 no hydrogen 3.013 N/A ASP 38.A N THR 41.A OG1 no hydrogen 3.108 N/A THR 41.A N ASP 38.A OD1 no hydrogen 3.253 N/A THR 41.A OG1 ASP 38.A O no hydrogen 2.932 N/A THR 41.A OG1 ASP 38.A OD1 no hydrogen 2.639 N/A LEU 42.A N ASP 38.A O no hydrogen 2.806 N/A TRP 43.A N ILE 39.A O no hydrogen 2.760 N/A GLN 44.A N GLU 40.A O no hydrogen 2.908 N/A ALA 45.A N THR 41.A O no hydrogen 2.847 N/A GLU 46.A N LEU 42.A O no hydrogen 2.992 N/A LYS 47.A N TRP 43.A O no hydrogen 3.064 N/A VAL 50.A N ALA 45.A O no hydrogen 2.937 N/A TRP 51.A N ALA 45.A O no hydrogen 3.097 N/A HIS 62.A N GLU 58.A O no hydrogen 2.868 N/A VAL 63.A N ILE 59.A O no hydrogen 3.100 N/A PHE 64.A N SER 60.A O no hydrogen 3.312 N/A TYR 65.A N VAL 61.A O no hydrogen 2.828 N/A TYR 65.A OH SER 246.A OG no hydrogen 3.174 N/A ARG 66.A N HIS 62.A O no hydrogen 2.981 N/A ARG 66.A NE GLU 46.A OE2 no hydrogen 2.879 N/A ARG 66.A NH2 GLU 46.A OE1 no hydrogen 2.766 N/A ARG 66.A NH2 GLU 46.A OE2 no hydrogen 3.552 N/A CYS 67.A N VAL 63.A O no hydrogen 2.961 N/A CYS 67.A SG VAL 63.A O no hydrogen 3.319 N/A GLN 68.A N PHE 64.A O no hydrogen 3.233 N/A GLN 68.A NE2 SER 246.A O no hydrogen 3.056 N/A CYS 69.A N.A TYR 65.A O no hydrogen 3.022 N/A CYS 69.A N.B TYR 65.A O no hydrogen 3.034 N/A CYS 69.A SG.B TYR 65.A O no hydrogen 3.287 N/A THR 70.A N ARG 66.A O no hydrogen 3.125 N/A THR 70.A OG1 ARG 66.A O no hydrogen 3.022 N/A THR 71.A N CYS 67.A O no hydrogen 2.881 N/A THR 71.A OG1 CYS 67.A O no hydrogen 2.538 N/A VAL 72.A N GLN 68.A O no hydrogen 2.906 N/A GLU 73.A N CYS 69.A O.A no hydrogen 3.015 N/A GLU 73.A N CYS 69.A O.B no hydrogen 3.002 N/A THR 74.A N THR 70.A O no hydrogen 3.036 N/A THR 74.A OG1 THR 70.A O no hydrogen 2.675 N/A VAL 75.A N THR 71.A O no hydrogen 2.970 N/A ARG 76.A N VAL 72.A O no hydrogen 3.106 N/A GLU 77.A N GLU 73.A O no hydrogen 3.209 N/A LEU 78.A N THR 74.A O no hydrogen 2.839 N/A THR 79.A N VAL 75.A O no hydrogen 2.814 N/A THR 79.A OG1 VAL 75.A O no hydrogen 2.768 N/A GLU 80.A N ARG 76.A O no hydrogen 2.936 N/A PHE 81.A N GLU 77.A O no hydrogen 2.859 N/A ALA 82.A N LEU 78.A O no hydrogen 2.992 N/A LYS 83.A N THR 79.A O no hydrogen 3.088 N/A LYS 83.A NZ GLU 80.A OE2 no hydrogen 3.084 N/A SER 84.A N GLU 80.A O no hydrogen 3.177 N/A SER 84.A N PHE 81.A O no hydrogen 3.051 N/A SER 84.A OG GLU 80.A O no hydrogen 2.785 N/A ILE 85.A N ALA 82.A O no hydrogen 2.734 N/A SER 89.A N ILE 85.A O no hydrogen 3.036 N/A SER 89.A OG LYS 83.A O no hydrogen 2.579 N/A SER 90.A N PRO 86.A O no hydrogen 3.053 N/A SER 90.A OG SER 87.A O no hydrogen 3.038 N/A LEU 91.A N PHE 88.A O no hydrogen 3.005 N/A ASP 95.A N PHE 92.A O no hydrogen 2.763 N/A GLN 96.A N PHE 92.A O no hydrogen 3.065 N/A GLN 96.A NE2 LEU 91.A O no hydrogen 2.890 N/A VAL 97.A N LEU 93.A O no hydrogen 3.151 N/A THR 98.A N ASN 94.A O no hydrogen 3.153 N/A THR 98.A OG1 ASN 94.A O no hydrogen 3.169 N/A LEU 99.A N ASP 95.A O no hydrogen 3.035 N/A LEU 100.A N GLN 96.A O no hydrogen 3.055 N/A LYS 101.A N VAL 97.A O no hydrogen 2.777 N/A LYS 101.A NZ ASP 257.A OD2 no hydrogen 2.838 N/A TYR 102.A N THR 98.A O no hydrogen 3.231 N/A GLY 103.A N LEU 99.A O no hydrogen 2.837 N/A GLY 103.A N LEU 100.A O no hydrogen 3.167 N/A VAL 104.A N LEU 100.A O no hydrogen 2.911 N/A ALA 107.A N GLY 103.A O no hydrogen 3.013 N/A ILE 108.A N VAL 104.A O no hydrogen 2.732 N/A PHE 109.A N HIS 105.A O no hydrogen 2.908 N/A ALA 110.A N GLU 106.A O no hydrogen 3.069 N/A MET 111.A N ALA 107.A O no hydrogen 2.962 N/A LEU 112.A N ILE 108.A O no hydrogen 2.969 N/A SER 114.A N MET 111.A O no hydrogen 3.045 N/A SER 114.A OG MET 111.A O no hydrogen 3.272 N/A ILE 115.A N LEU 112.A O no hydrogen 2.927 N/A ASN 117.A N GLY 120.A O no hydrogen 3.084 N/A ASP 119.A N ASN 117.A OD1 no hydrogen 2.854 N/A GLY 120.A N ASN 117.A OD1 no hydrogen 3.294 N/A LEU 121.A N VAL 130.A O no hydrogen 2.838 N/A LEU 122.A N ILE 115.A O no hydrogen 2.916 N/A VAL 123.A N GLY 128.A O no hydrogen 2.791 N/A GLY 126.A N VAL 123.A O no hydrogen 3.201 N/A SER 127.A N ALA 124.A O no hydrogen 3.124 N/A SER 127.A OG ALA 124.A O no hydrogen 3.263 N/A GLY 128.A N VAL 123.A O no hydrogen 3.158 N/A PHE 129.A N PHE 34.A O no hydrogen 2.900 N/A VAL 130.A N LEU 121.A O no hydrogen 2.916 N/A THR 131.A N ILE 36.A O no hydrogen 3.039 N/A ARG 132.A N ASP 119.A O no hydrogen 2.708 N/A ARG 132.A NH1 LYS 118.A O no hydrogen 3.489 N/A ARG 132.A NH2 GLU 147.A OE2 no hydrogen 2.689 N/A PHE 134.A N THR 131.A OG1 no hydrogen 3.173 N/A LEU 135.A N THR 131.A O no hydrogen 3.273 N/A ARG 136.A N ARG 132.A O no hydrogen 3.096 N/A ARG 136.A NE GLU 147.A OE1 no hydrogen 3.081 N/A ARG 136.A NH1 GLU 133.A OE1 no hydrogen 2.978 N/A SER 137.A N GLU 133.A O no hydrogen 3.211 N/A SER 137.A N PHE 134.A O no hydrogen 3.303 N/A SER 137.A OG PHE 134.A O no hydrogen 2.467 N/A ARG 139.A N SER 60.A OG no hydrogen 2.934 N/A ARG 139.A NE GLU 58.A OE1 no hydrogen 3.072 N/A ARG 139.A NE GLU 58.A OE2 no hydrogen 3.024 N/A ARG 139.A NH1 GLU 58.A OE2 no hydrogen 2.892 N/A ARG 139.A NH1 GLU 242.A OE1 no hydrogen 2.666 N/A ARG 139.A NH2 LYS 140.A O no hydrogen 2.859 N/A ARG 139.A NH2 GLU 242.A OE1 no hydrogen 3.278 N/A LYS 140.A NZ ASP 144.A OD1 no hydrogen 3.019 N/A PHE 142.A N ARG 139.A O no hydrogen 2.983 N/A SER 143.A N ARG 139.A O no hydrogen 3.224 N/A SER 143.A OG ASP 144.A OD1 no hydrogen 3.284 N/A ILE 145.A N PHE 142.A O no hydrogen 3.284 N/A LYS 149.A NZ ILE 145.A O no hydrogen 2.825 N/A LYS 149.A NZ HIS 231.A ND1 no hydrogen 2.860 N/A PHE 150.A N ILE 146.A O no hydrogen 3.254 N/A GLU 151.A N GLU 147.A O no hydrogen 3.151 N/A PHE 152.A N PRO 148.A O no hydrogen 3.029 N/A ALA 153.A N LYS 149.A O no hydrogen 2.868 N/A VAL 154.A N PHE 150.A O no hydrogen 3.098 N/A LYS 155.A N GLU 151.A O no hydrogen 3.513 N/A PHE 156.A N PHE 152.A O no hydrogen 2.874 N/A ASN 157.A N ALA 153.A O no hydrogen 3.055 N/A ASN 157.A ND2 ALA 113.A O no hydrogen 2.632 N/A LEU 159.A N PHE 156.A O no hydrogen 2.917 N/A GLU 160.A N ASN 157.A O no hydrogen 2.981 N/A ASP 162.A N ASP 165.A OD2 no hydrogen 2.826 N/A SER 164.A OG ASP 162.A OD1 no hydrogen 2.549 N/A SER 164.A OG HIS 202.A NE2 no hydrogen 3.046 N/A ASP 165.A N ASP 162.A O no hydrogen 2.968 N/A ASP 165.A N ASP 162.A OD1 no hydrogen 3.244 N/A LEU 166.A N ASP 162.A O no hydrogen 3.060 N/A ALA 167.A N ASP 163.A O no hydrogen 2.824 N/A PHE 169.A N ASP 165.A O no hydrogen 2.979 N/A ILE 170.A N LEU 166.A O no hydrogen 2.757 N/A ALA 171.A N ALA 167.A O no hydrogen 3.086 N/A ALA 172.A N LEU 168.A O no hydrogen 2.978 N/A ILE 173.A N PHE 169.A O no hydrogen 2.968 N/A ILE 174.A N ILE 170.A O no hydrogen 3.066 N/A LEU 175.A N ALA 171.A O no hydrogen 2.914 N/A CYS 176.A SG ASP 178.A OD1 no hydrogen 3.609 N/A ARG 179.A NH1 GLU 106.A OE2 no hydrogen 3.169 N/A ARG 179.A NH2 GLU 106.A OE1 no hydrogen 2.913 N/A ARG 179.A NH2 ILE 173.A O no hydrogen 2.965 N/A LEU 182.A N ARG 179.A O no hydrogen 3.415 N/A MET 183.A N ASP 95.A OD1 no hydrogen 2.754 N/A ASN 184.A N ASP 95.A OD2 no hydrogen 3.127 N/A VAL 188.A N ASN 184.A O no hydrogen 3.288 N/A GLU 189.A N VAL 185.A O no hydrogen 2.871 N/A ALA 190.A N PRO 186.A O no hydrogen 2.881 N/A ILE 191.A N ARG 187.A O no hydrogen 3.036 N/A GLN 192.A N VAL 188.A O no hydrogen 2.933 N/A GLN 192.A NE2 ALA 172.A O no hydrogen 3.482 N/A ASP 193.A N GLU 189.A O no hydrogen 2.958 N/A THR 194.A N ALA 190.A O no hydrogen 3.262 N/A THR 194.A OG1 ALA 190.A O no hydrogen 3.223 N/A ILE 195.A N ILE 191.A O no hydrogen 3.082 N/A LEU 196.A N GLN 192.A O no hydrogen 2.806 N/A ARG 197.A N ASP 193.A O no hydrogen 2.944 N/A ARG 197.A NE ASP 193.A OD2 no hydrogen 3.039 N/A ALA 198.A N THR 194.A O no hydrogen 2.891 N/A LEU 199.A N ILE 195.A O no hydrogen 2.719 N/A GLU 200.A N LEU 196.A O no hydrogen 2.924 N/A PHE 201.A N ARG 197.A O no hydrogen 2.951 N/A HIS 202.A N ALA 198.A O no hydrogen 2.830 N/A HIS 202.A NE2 SER 164.A OG no hydrogen 3.046 N/A LEU 203.A N LEU 199.A O no hydrogen 2.822 N/A GLN 204.A N GLU 200.A O no hydrogen 3.327 N/A GLN 204.A N PHE 201.A O no hydrogen 3.150 N/A ALA 205.A N PHE 201.A O no hydrogen 3.327 N/A ASN 206.A N HIS 202.A O no hydrogen 2.980 N/A ASN 206.A ND2 ASP 162.A OD1 no hydrogen 3.234 N/A ASN 206.A ND2 ASP 162.A OD2 no hydrogen 2.667 N/A ASN 206.A ND2 ASP 165.A OD1 no hydrogen 2.883 N/A HIS 207.A N LEU 203.A O no hydrogen 2.945 N/A HIS 207.A NE2 ASP 165.A OD2 no hydrogen 2.839 N/A ALA 210.A N HIS 207.A O no hydrogen 3.338 N/A LYS 216.A N TYR 212.A O no hydrogen 3.067 N/A LEU 217.A N LEU 213.A O no hydrogen 3.033 N/A LEU 218.A N PHE 214.A O no hydrogen 3.076 N/A GLN 219.A N PRO 215.A O no hydrogen 3.095 N/A GLN 219.A NE2 ASP 223.A OD1 no hydrogen 3.144 N/A LYS 220.A N LYS 216.A O no hydrogen 3.006 N/A MET 221.A N LEU 217.A O no hydrogen 3.279 N/A MET 221.A N LEU 218.A O no hydrogen 3.013 N/A ALA 222.A N LEU 218.A O no hydrogen 3.342 N/A ASP 223.A N GLN 219.A O no hydrogen 3.023 N/A LEU 224.A N LYS 220.A O no hydrogen 2.987 N/A ARG 225.A N MET 221.A O no hydrogen 3.283 N/A ARG 225.A NH1 MET 221.A O no hydrogen 3.567 N/A GLN 226.A N ALA 222.A O no hydrogen 3.329 N/A LEU 227.A N ASP 223.A O no hydrogen 2.929 N/A VAL 228.A N LEU 224.A O no hydrogen 2.915 N/A THR 229.A N ARG 225.A O no hydrogen 2.988 N/A THR 229.A OG1 ARG 225.A O no hydrogen 3.046 N/A GLU 230.A N GLN 226.A O no hydrogen 3.048 N/A HIS 231.A N LEU 227.A O no hydrogen 2.883 N/A HIS 231.A NE2 TYR 255.A OH no hydrogen 2.796 N/A ALA 232.A N VAL 228.A O no hydrogen 2.845 N/A GLN 233.A N THR 229.A O no hydrogen 3.036 N/A MET 234.A N GLU 230.A O no hydrogen 3.283 N/A MET 235.A N HIS 231.A O no hydrogen 3.016 N/A GLN 236.A N ALA 232.A O no hydrogen 3.114 N/A ILE 238.A N MET 234.A O no hydrogen 3.132 N/A LYS 239.A N MET 235.A O no hydrogen 3.047 N/A LYS 240.A N GLN 236.A O no hydrogen 3.058 N/A THR 241.A N ARG 237.A O no hydrogen 2.865 N/A THR 241.A OG1 ARG 237.A O no hydrogen 2.615 N/A GLU 242.A N ILE 238.A O no hydrogen 2.904 N/A THR 245.A N GLU 242.A O no hydrogen 3.046 N/A SER 246.A N TYR 65.A OH no hydrogen 3.030 N/A SER 246.A OG TYR 65.A OH no hydrogen 3.174 N/A HIS 248.A N GLN 68.A OE1 no hydrogen 2.698 N/A LEU 250.A N HIS 248.A ND1 no hydrogen 3.013 N/A LEU 251.A N HIS 248.A O no hydrogen 2.756 N/A GLN 252.A N HIS 248.A O no hydrogen 3.076 N/A GLU 253.A N PRO 249.A O no hydrogen 2.914 N/A ILE 254.A N LEU 250.A O no hydrogen 3.228 N/A TYR 255.A N LEU 251.A O no hydrogen 2.824 N/A TYR 255.A OH HIS 105.A NE2 no hydrogen 2.750 N/A LYS 256.A N GLN 252.A O no hydrogen 3.094 N/A